0 mol 7 unq 0 iso 0 dist 8.85869 9.02286 5.03532 14.1047 9.85726 6.44736 19.2577 11.5784 12.2869 9.60499 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.5298 9.02286 4.45508 14.06 7.21217 10.2313 12.3221 6.09254 6.61022 7.10621 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.58709 8.74005 5.3991 9.69698 9.74445 13.3156 15.7652 10.323 15.4052 8.80331 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.58709 8.74005 5.3991 9.69698 9.74445 13.3156 15.8918 14.445 18.5655 6.20293 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 6.10175 9.57335 11.14 5.65405 5.59773 10.1454 14.4402 13.9079 18.3033 9.5589 numMergedOcc 0
5 mol 54 unq 1 iso 0 dist 6.10175 9.57335 11.14 5.65405 5.59773 10.1454 10.5929 10.4238 16.7609 6.83299 numMergedOcc 0
6 mol 54 unq 2 iso 0 dist 6.10175 9.57335 11.14 5.65405 5.59773 10.1454 6.54183 10.1356 4.15717 8.10861 numMergedOcc 0
7 mol 54 unq 3 iso 0 dist 6.10175 8.60653 7.93241 5.65405 5.59773 7.21717 14.4402 13.9079 15.293 9.5589 numMergedOcc 0
8 mol 54 unq 4 iso 0 dist 6.10175 8.60653 7.93241 5.65405 5.59773 7.21717 10.5929 10.4238 13.86 6.83299 numMergedOcc 0
9 mol 54 unq 5 iso 0 dist 6.10175 8.60653 7.93241 5.65405 5.59773 7.21717 6.54183 10.1356 5.99981 8.10861 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 8.26291 6.87196 7.91054 10.9365 7.83619 7.96646 13.2314 10.0837 6.73735 9.28393 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 5.50364 5.43662 4.17212 5.29825 8.97145 8.70296 12.0117 14.257 14.2045 6.85062 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.7301 5.43662 9.64263 5.29825 6.5874 8.70296 12.0117 7.60371 14.2045 6.85062 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 4.35909 8.50938 6.70394 5.32859 7.44191 6.46704 11.0615 9.60754 4.43096 8.03334 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 5.77393 8.50938 10.8517 5.32859 6.00053 6.46704 11.0615 11.1879 4.43096 8.03334 numMergedOcc 0
15 mol 220 unq 0 iso 0 dist 8.58709 7.58118 4.39102 5.1021 9.8711 6.59716 6.21273 4.90657 7.11498 9.23153 numMergedOcc 0
16 mol 220 unq 1 iso 0 dist 4.3362 9.75868 11.317 9.20027 7.31105 13.5821 17.1012 14.6296 22.8043 9.23153 numMergedOcc 0
17 mol 220 unq 2 iso 0 dist 4.3362 9.75868 11.317 9.20027 7.31105 13.5821 13.6374 9.52692 17.4334 8.24498 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 7.99145 6.65275 5.75236 5.841 9.17826 5.41321 14.1483 16.2594 10.7656 9.34734 numMergedOcc 0
19 mol 227 unq 1 iso 0 dist 7.99145 6.65275 5.75236 5.841 9.17826 5.41321 12.9898 14.9329 10.9607 7.22101 numMergedOcc 0
20 mol 227 unq 2 iso 0 dist 7.99145 6.65275 5.75236 5.841 9.17826 5.41321 14.1659 13.2783 9.72615 8.65997 numMergedOcc 0
21 mol 227 unq 3 iso 0 dist 7.99145 6.65275 5.75236 5.841 9.17826 5.41321 9.8971 10.6504 5.10635 7.56888 numMergedOcc 0
22 mol 227 unq 4 iso 0 dist 7.99145 6.65275 5.75236 5.841 9.17826 5.41321 7.71761 11.4528 6.48027 7.55216 numMergedOcc 0
23 mol 239 unq 0 iso 0 dist 4.21935 9.25097 5.51771 4.77446 6.37342 11.5039 6.83046 5.29737 9.59042 6.16342 numMergedOcc 0
24 mol 252 unq 0 iso 0 dist 9.42193 9.1191 5.53685 14.864 9.73021 11.0831 20.6773 16.5881 19.1145 8.33025 numMergedOcc 0
25 mol 252 unq 1 iso 0 dist 9.42193 9.1191 5.53685 14.864 9.73021 11.0831 19.2417 12.5855 16.9237 9.2288 numMergedOcc 0
26 mol 252 unq 2 iso 0 dist 9.42193 9.1191 5.53685 14.864 9.73021 11.0831 13.4304 5.26867 6.35641 7.19638 numMergedOcc 0
27 mol 274 unq 0 iso 0 dist 9.2447 9.52471 13.8071 6.12463 9.696 11.3758 12.2117 10.7962 12.5133 7.56915 numMergedOcc 0
28 mol 274 unq 1 iso 0 dist 9.2447 9.52471 13.8071 6.12463 9.696 11.3758 10.1296 5.1874 11.5303 8.49997 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 9.42812 7.88238 5.10104 16.2915 6.90434 10.8214 20.3589 13.2927 17.1051 9.7748 numMergedOcc 0
30 mol 280 unq 0 iso 0 dist 9.9227 9.55885 12.0238 5.80223 8.85762 14.3936 8.80588 4.95798 14.1713 6.0664 numMergedOcc 0
